SCHEMBL733837

SCHEMBL733837

CC(C)(C)c1ccc(OCC(=O)Nc2nc3c(ncn3[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO)O3)c(=O)[nH]2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
POLA1 P09884 1/20 0.45
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
ALDH1A1 P00352 1/20 0.39
P2RY1 P47900 1/20 0.37
ADORA1 P30542 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA2B P29275 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL734168 0.93 KDM4E (0.46) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1
SCHEMBL734937 0.89 POLA1 (0.56) KDM4EPOLA1TAS1R3TAS1R1POLB
SCHEMBL732905 0.87 KDM4E (0.43) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1
SCHEMBL31098030 0.85 KDM4E (0.57) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1
SCHEMBL9703289 0.84 KDM4E (0.74) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1
SCHEMBL22315215 0.84 KDM4E (0.74) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1
SCHEMBL3024229 0.84 KDM4E (0.45) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1
SCHEMBL733738 0.83 KDM4E (0.41) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1
SCHEMBL25398969 0.81 KDM4E (0.48) KDM4EPOLA1TAS1R3TAS1R1P2RY1
SCHEMBL889631 0.80 KDM4E (0.53) KDM4EPOLA1TAS1R3TAS1R1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138330-B2 Solid phase synthesis via deblocking immobilized nucleoside, then coupling acyl protected nucleoside phosphoramidite SIGMA-ALDRICH CO. LLC (US) 2012-03-20 US disclosed
US-20080064867-A1 PROCESS FOR THE SYNTHESIS OF OLIGONUCLEOTIDES SIGMA ALDRICH COMPANY (US) 2008-03-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080064867-A1 PROCESS FOR THE SYNTHESIS OF OLIGONUCLEOTIDES RNGTT, DUT, ADAR KDM4E 1717/4885POLA1 52/4885TAS1R3 4448/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.